Geometry & MOs

Info

ID:	76192
PubChem CID:	48424571
Reduced:	O4N5C20H23 (1)
Stoich.:	A4B5C20D23 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-95.02
Dipole, Da:	4.91
IP(EA), eV:	-8.78(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[4-(N-methylanilino)butylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCCCN2C(=O)N3C=CC=CC3=N2

DOS

IR

Vibrations