Geometry & MOs

Info

ID:	359867
PubChem CID:	127299911
Reduced:	O4N5C18H29 (1)
Stoich.:	A4B5C18D29 (1)
Weight, g/mol:	381.216475
ΔH_f, kcal/mol:	-111.22
Dipole, Da:	8.12
IP(EA), eV:	-8.84(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(1-morpholin-4-yl-1-oxopropan-2-yl)piperazin-1-yl]methyl]indolizine-1-carbonitrile

Drug info:

PubChemData

Smile

CC1=NOC(=C1)NC(=O)C(C)N2CCN(CC2)C(C)C(=O)N3CCOCC3

DOS

IR

Vibrations