Geometry & MOs

Info

ID:	415403
PubChem CID:	135088397
Reduced:	O2N3C15H29 (1)
Stoich.:	A2B3C15D29 (1)
Weight, g/mol:	607.336984
ΔH_f, kcal/mol:	-132.34
Dipole, Da:	5.1
IP(EA), eV:	-9.29(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(7S,10R)-17-acetyl-4-[(2S)-butan-2-yl]-7-[(4-methoxyphenyl)methyl]-10-methyl-3,6,9,12,17-pentazabicyclo[17.2.2]tricosa-1(21),19,22-triene-2,5,8,11-tetrone

Drug info:

PubChemData

Smile

CCN(CCC(=O)NC1CCCCCC1)C(C)C(=O)N

DOS

IR

Vibrations