Geometry & MOs

Info

ID:	366822
PubChem CID:	127320400
Reduced:	N2O2C7H10 (2)
Stoich.:	A2B2C7D10 (2)
Weight, g/mol:	307.225977
ΔH_f, kcal/mol:	-92.38
Dipole, Da:	3.56
IP(EA), eV:	-9.47(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(azepan-1-yl)propanoyl]-N-cyclopropylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NOC(=N1)COCC(=O)N2CCCC2C(=O)NC3CC3

DOS

IR

Vibrations