Geometry & MOs

Info

ID:	172396
PubChem CID:	75503882
Reduced:	O2N3C16H31 (1)
Stoich.:	A2B3C16D31 (1)
Weight, g/mol:	312.12407
ΔH_f, kcal/mol:	-126.52
Dipole, Da:	3.56
IP(EA), eV:	-8.41(1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-chloro-2-methoxyphenyl)methyl]-3-(1-hydroxyethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCCN(C1)CCCNC(=O)N2CCC(C2)C(C)O

DOS

IR

Vibrations